Geometry & MOs

Info

ID:	448060
PubChem CID:	135288097
Reduced:	FSO3N8H27C31 (1)
Stoich.:	ABC3D8E27F31 (1)
Weight, g/mol:	346.135114
ΔH_f, kcal/mol:	31.83
Dipole, Da:	6.76
IP(EA), eV:	-8.4(-1.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-hydroxyanilino)-5,5,7,7-tetramethyl-4H-thieno[2,3-c]pyran-3-carboxamide

Drug info:

PubChemData

Smile

CS(=O)(=O)C(C1=CC(=CC(=C1)C2=CN=CC3=N/C(=C/4\C5=C(NN4)N=CC(=C5)C6=CC(=CN=C6)NC(=O)C7CCC7)/C=C23)F)N

DOS

IR

Vibrations